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canSAR394182
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NAMES
    SMILES
    CCC(C)c1nc(NCc2ccccc2)c2sccc2n1
    InChI
    InChI=1S/C17H19N3S/c1-3-12(2)16-19-14-9-10-21-15(14)17(20-16)18-11-13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,18,19,20)
    MOLECULAR FORMULA
    C17H19N3S
    CROSS REFERENCES
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    canSAR394182

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.13
    AlogP 4.82
    HBond donors 1
    HBond acceptors 3
    Atoms 40
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR394182.